1-(1-butyl-2,5-dimethyl-6-oxidanyl-benzimidazol-1-ium-1-yl)butan-1-one

Systemtic Name: 1-(1-butyl-2,5-dimethyl-6-oxidanyl-benzimidazol-1-ium-1-yl)butan-1-one Openeye Name: 1-(1-butyl-6-hydroxy-2,5-dimethyl-benzimidazol-1-ium-1-yl)butan-1-one CAS Name: 1-(1-butyl-6-hydroxy-2,5-dimethyl-1-benzimidazol-1-iumyl)-1-butanone IUPAC Name: 1-(1-butyl-6-hydroxy-2,5-dimethylbenzimidazol-1-ium-1-yl)butan-1-one Traditional Name: 1-(1-butyl-6-hydroxy-2,5-dimethyl-benzimidazol-1-ium-1-yl)butan-1-one Formula: C17H25N2O2+ MolecularWeight: 289.3926

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(C(=NC2=C1C=C(C(=C2)C)O)C)C(=O)CCC

Isomeric SMILES

CCCC[N+]1(C(=NC2=C1C=C(C(=C2)C)O)C)C(=O)CCC

InChI

InChI=1S/C17H24N2O2/c1-5-7-9-19(17(21)8-6-2)13(4)18-14-10-12(3)16(20)11-15(14)19/h10-11H,5-9H2,1-4H3/p+1